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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg7-Jul-2020HMECP0asBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31G* SDD GENECP-9867.35954294; Eh
thumbnail.jpeg7-Jul-2020I7s_aBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point Structure-6-31G* SDD-10894.2360422; Eh
thumbnail.jpeg7-Jul-2020MECP1s_aBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31G* SDD GENECP-10019.8203369; Eh
thumbnail.jpeg7-Jul-2020HMECP1btBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31G* SDD GENECP-9867.39076113; Eh
thumbnail.jpeg7-Jul-2020HMECP0atBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31G* SDD GENECP-9867.35954946; Eh
thumbnail.jpeg7-Jul-2020HMECP0btBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31G* SDD GENECP-9867.36559175; Eh
thumbnail.jpeg7-Jul-2020HMECP1bsBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31G* SDD GENECP-9867.39075838; Eh
thumbnail.jpeg7-Jul-2020HMECP1asBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31G* SDD GENECP-9867.38949994; Eh
thumbnail.jpeg7-Jul-2020HMECP1atBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31G* SDD GENECP-9867.38951727; Eh
thumbnail.jpeg7-Jul-2020MECP2tBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31G* SDD GENECP-10894.2101861; Eh
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